2-methyl-4-(phenylcarbonyl)-5-(trifluoromethyl)-1H-pyrazol-3-one

Systemtic Name: 2-methyl-4-(phenylcarbonyl)-5-(trifluoromethyl)-1H-pyrazol-3-one Openeye Name: 4-benzoyl-2-methyl-5-(trifluoromethyl)-1H-pyrazol-3-one CAS Name: 4-benzoyl-2-methyl-5-(trifluoromethyl)-1H-pyrazol-3-one IUPAC Name: 4-benzoyl-2-methyl-5-(trifluoromethyl)-1H-pyrazol-3-one Traditional Name: 4-benzoyl-2-methyl-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C12H9F3N2O2 MolecularWeight: 270.20727

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N1)C(F)(F)F)C(=O)C2=CC=CC=C2

Isomeric SMILES

CN1C(=O)C(=C(N1)C(F)(F)F)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H9F3N2O2/c1-17-11(19)8(10(16-17)12(13,14)15)9(18)7-5-3-2-4-6-7/h2-6,16H,1H3